S-(1-methylimidazol-2-yl) 2,2,2-tris(fluoranyl)ethanethioate

Systemtic Name: S-(1-methylimidazol-2-yl) 2,2,2-tris(fluoranyl)ethanethioate Openeye Name: S-(1-methylimidazol-2-yl) 2,2,2-trifluoroethanethioate CAS Name: 2,2,2-trifluoroethanethioic acid S-(1-methyl-2-imidazolyl) ester IUPAC Name: S-(1-methylimidazol-2-yl) 2,2,2-trifluoroethanethioate Traditional Name: 2,2,2-trifluoroethanethioic acid S-(1-methylimidazol-2-yl) ester Formula: C6H5F3N2OS MolecularWeight: 210.17691

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC(=O)C(F)(F)F

Isomeric SMILES

CN1C=CN=C1SC(=O)C(F)(F)F

InChI

InChI=1S/C6H5F3N2OS/c1-11-3-2-10-5(11)13-4(12)6(7,8)9/h2-3H,1H3